CHEBI:77729 - tenovin-6

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ChEBI Name tenovin-6
ChEBI ID CHEBI:77729
Definition A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 5-(dimethylamino)pentanoic acid with the aromatic amino group of N-[(4-aminophenyl)carbamothioyl]-4-tert-butylbenzamide.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C25H34N4O2S
Net Charge 0
Average Mass 454.62800
Monoisotopic Mass 454.24025
InChI InChI=1S/C25H34N4O2S/c1-25(2,3)19-11-9-18(10-12-19)23(31)28-24(32)27-21-15-13-20(14-16-21)26-22(30)8-6-7-17-29(4)5/h9-16H,6-8,17H2,1-5H3,(H,26,30)(H2,27,28,31,32)
InChIKey BVJSXSQRIUSRCO-UHFFFAOYSA-N
SMILES CN(C)CCCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)cc1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): Sir2 inhibitor
An EC 3.5.1.98 (histone deacetylase) inhibitor that interferes with the action of Sir2.
p53 activator
Any activator of tumour protein p53.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing tenovin-6 (CHEBI:77729) has role antineoplastic agent (CHEBI:35610)
tenovin-6 (CHEBI:77729) has role p53 activator (CHEBI:77731)
tenovin-6 (CHEBI:77729) has role Sir2 inhibitor (CHEBI:71181)
tenovin-6 (CHEBI:77729) is a monocarboxylic acid amide (CHEBI:29347)
tenovin-6 (CHEBI:77729) is a tertiary amino compound (CHEBI:50996)
tenovin-6 (CHEBI:77729) is a thioureas (CHEBI:51276)
IUPAC Name
4-tert-butyl-N-[(4-{[5-(dimethylamino)pentanoyl]amino}phenyl)carbamothioyl]benzamide
Registry Number Type Source
13113367 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
22517433 PubMed citation Europe PMC
23029150 PubMed citation Europe PMC
23429453 PubMed citation Europe PMC
23460888 PubMed citation Europe PMC
24512730 PubMed citation Europe PMC
Last Modified
17 March 2014